For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Heneicosanoic acid, 3,20,20-trimethyl-, methyl ester
SpectraBase Compound ID IRdTZfwoR24
InChI InChI=1S/C25H50O2/c1-23(22-24(26)27-5)20-18-16-14-12-10-8-6-7-9-11-13-15-17-19-21-25(2,3)4/h23H,6-22H2,1-5H3
InChIKey OUIZSTMJYPOTOW-UHFFFAOYSA-N
Mol Weight 382.7 g/mol
Molecular Formula C25H50O2
Exact Mass 382.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6DdwxEHdRK
Name Heneicosanoic acid, 3,20,20-trimethyl-, methyl ester
Alternate Name(s) Methyl 3,20,20-trimethylhenicosanoate 3,20,20-trimethylheneicosanoic acid methyl ester Methyl 3,20,20-trimethylheneicosanoate
CAS Registry Number 55334-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H50O2
InChI InChI=1S/C25H50O2/c1-23(22-24(26)27-5)20-18-16-14-12-10-8-6-7-9-11-13-15-17-19-21-25(2,3)4/h23H,6-22H2,1-5H3
InChIKey OUIZSTMJYPOTOW-UHFFFAOYSA-N
Molecular Weight 382.673 g/mol
SMILES C(CC(CCCCCCCCCCCCCCCCC(C)(C)C)C)(=O)OC
SPLASH splash10-0kk9-9403000000-c65a4fb30bd6cb1b53b7
Source of Spectrum JX-2015-6-6770
Wiley ID 1729481